6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine

C18H17ClF3N5 — CID 19367117

IUPAC6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESFC(F)(F)c1ccc(N2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)nc1
InChIInChI=1S/C18H17ClF3N5/c19-14-2-4-17-24-15(12-27(17)10-14)11-25-5-7-26(8-6-25)16-3-1-13(9-23-16)18(20,21)22/h1-4,9-10,12H,5-8,11H2
InChIKeyZQDZGCSQBJXGKJ-UHFFFAOYSA-N
MW395.82 g/mol
LogP3.72
Rot. Bonds3

About 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine

6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine (PubChem CID 19367117) has the molecular formula C18H17ClF3N5 and a molecular weight of 395.82 g/mol. Its IUPAC name is 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
PubChem CID19367117
Molecular FormulaC18H17ClF3N5
Molecular Weight395.82 g/mol
Exact Mass395.11
IUPAC Name6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
SMILESFC(F)(F)c1ccc(N2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)nc1
InChIInChI=1S/C18H17ClF3N5/c19-14-2-4-17-24-15(12-27(17)10-14)11-25-5-7-26(8-6-25)16-3-1-13(9-23-16)18(20,21)22/h1-4,9-10,12H,5-8,11H2
InChIKeyZQDZGCSQBJXGKJ-UHFFFAOYSA-N
XLogP3.72
TPSA36.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.82
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine (CID 19367117) is 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine is FC(F)(F)c1ccc(N2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)nc1.
What is the InChIKey of 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
The InChIKey is ZQDZGCSQBJXGKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClF3N5/c19-14-2-4-17-24-15(12-27(17)10-14)11-25-5-7-26(8-6-25)16-3-1-13(9-23-16)18(20,21)22/h1-4,9-10,12H,5-8,11H2.
What are the key properties of 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine?
6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine has a molecular weight of 395.82 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 19367117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).